SCHEMBL1854536

SCHEMBL1854536

N#CCCNC(=O)c1cccc(-c2cccc3oc(Cc4cccc(C(F)(F)F)c4)nc23)c1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 16/20 0.57
CDK8 P49336 1/20 0.42
SNCA P37840 1/20 0.42
CNR2 P34972 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3212707 0.90 GPR52 (0.71) GPR52CNR2
SCHEMBL1856133 0.84 GPR52 (0.81) GPR52SNCAALDH1A1POLB
SCHEMBL1855792 0.83 GPR52 (0.51) GPR52CNR2ALDH1A1
SCHEMBL3219273 0.83 GPR52 (0.63) GPR52CDK8ALDH1A1POLB
SCHEMBL1846506 0.82 GPR52 (0.81) GPR52CDK8SNCAALDH1A1POLB
SCHEMBL3198028 0.82 GPR52 (0.53) GPR52CDK8ALDH1A1POLB
SCHEMBL1851150 0.81 GPR52 (0.81) GPR52
SCHEMBL1856214 0.80 GPR52 (0.50) GPR52CDK8
SCHEMBL1852406 0.80 GPR52 (0.66) GPR52CDK8SNCA
SCHEMBL3211066 0.80 GPR52 (0.81) GPR52SNCAALDH1A1POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2323978-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-05-25 EP disclosed
WO-2010018874-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO disclosed
WO-2010018874-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO disclosed
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 US disclosed
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 US disclosed
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100041891-A1 AMIDE COMPOUND GPR52, GPR132, NR5A2 GPR52 1/4885CDK8 3401/4885SNCA 2055/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.